Vitas-M small molecule compound

N-[(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-isoleucine

Catalog ID
STL532206
SMILES CC[C@H]([C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)OC)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H25NO7 MW 391.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO7/c1-6-10(2)18(19(23)24)21-16(22)9-13-11(3)17-14(27-5)7-12(26-4)8-15(17)28-20(13)25/h7-8,10,18H,6,9H2,1-5H3,(H,21,22)(H,23,24)/t10-,18+/m1/s1
InChIKey
CVKXDNWVGBEKML-MGNBDDOMSA-N
Synonyms
956047-98-6
(2~(S)3~(R))2((2(57dimethoxy4methyl2oxochromen3yl)acetyl)amino)3methylpentanoicacid
(2S3R)2((2(57DIMETHOXY4METHYL2OXOCHROMEN3YL)ACETYL)AMINO)3METHYLPENTANOICACID
(2S3R)2(2(57dimethoxy4methyl2oxo2Hchromen3yl)acetamido)3methylpentanoicacid
1777805
956047986
CC(C@H)((C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)OC)C
InChI=1SC20H25NO7c1610(2)18(19(23)24)2116(22)91311(3)1714(275)712(264)815(17)2820(13)25h781018H69H215H3(H2122)(H2324)t1018+m1s1
MFCD05676317
N((57dimethoxy4methyl2oxo2Hchromen3yl)acetyl)Lisoleucine
ZINC000002123023
ZINC2123023

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Available files

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